3-(1-azabicyclo[2.2.2]octan-3-yl)-5-methyl-2H-isoquinolin-1-one

Systemtic Name: 3-(1-azabicyclo[2.2.2]octan-3-yl)-5-methyl-2H-isoquinolin-1-one Openeye Name: 5-methyl-3-quinuclidin-3-yl-2H-isoquinolin-1-one CAS Name: 3-(1-azabicyclo[2.2.2]octan-3-yl)-5-methyl-2H-isoquinolin-1-one IUPAC Name: 3-(1-azabicyclo[2.2.2]octan-3-yl)-5-methyl-2H-isoquinolin-1-one Traditional Name: 5-methyl-3-quinuclidin-3-yl-isocarbostyril Formula: C17H20N2O MolecularWeight: 268.3535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)C3CN4CCC3CC4

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)C3CN4CCC3CC4

InChI

InChI=1S/C17H20N2O/c1-11-3-2-4-13-14(11)9-16(18-17(13)20)15-10-19-7-5-12(15)6-8-19/h2-4,9,12,15H,5-8,10H2,1H3,(H,18,20)